2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane

C28H36N4Si4 — CID 12550610

IUPAC2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane
SMILESC[Si]1(C)N[Si](c2ccccc2)(c2ccccc2)N[Si](C)(C)N[Si](c2ccccc2)(c2ccccc2)N1
InChIInChI=1S/C28H36N4Si4/c1-33(2)29-35(25-17-9-5-10-18-25,26-19-11-6-12-20-26)31-34(3,4)32-36(30-33,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h5-24,29-32H,1-4H3
InChIKeyYNOZKSPILZAVEV-UHFFFAOYSA-N
MW540.97 g/mol
LogP2.28
Rot. Bonds4

About 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane

2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane (PubChem CID 12550610) has the molecular formula C28H36N4Si4 and a molecular weight of 540.97 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane
PubChem CID12550610
Molecular FormulaC28H36N4Si4
Molecular Weight540.97 g/mol
Exact Mass540.20
IUPAC Name2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane
SMILESC[Si]1(C)N[Si](c2ccccc2)(c2ccccc2)N[Si](C)(C)N[Si](c2ccccc2)(c2ccccc2)N1
InChIInChI=1S/C28H36N4Si4/c1-33(2)29-35(25-17-9-5-10-18-25,26-19-11-6-12-20-26)31-34(3,4)32-36(30-33,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h5-24,29-32H,1-4H3
InChIKeyYNOZKSPILZAVEV-UHFFFAOYSA-N
XLogP2.28
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500540.97
LogP ≤ 52.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane?
The IUPAC name of 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane (CID 12550610) is 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane.
What is the SMILES notation for 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane?
The canonical SMILES for 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane is C[Si]1(C)N[Si](c2ccccc2)(c2ccccc2)N[Si](C)(C)N[Si](c2ccccc2)(c2ccccc2)N1.
What is the InChIKey of 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane?
The InChIKey is YNOZKSPILZAVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H36N4Si4/c1-33(2)29-35(25-17-9-5-10-18-25,26-19-11-6-12-20-26)31-34(3,4)32-36(30-33,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h5-24,29-32H,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane?
2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane has a molecular weight of 540.97 g/mol, XLogP of 2.28, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-4,4,8,8-tetraphenyl-1,3,5,7,2,4,6,8-tetrazatetrasilocane is sourced from PubChem (CID 12550610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).